{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.48581 0 0 ] "si-unit" "m" "si-value" [ 5.48581e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00228581 5.44331 0 ] "si-unit" "m" "si-value" [ 2.28581e-13 5.44331e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0206328 -0.0957916 5.42731 ] "si-unit" "m" "si-value" [ -2.06328e-12 -9.57916e-12 5.427310000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00584564 0.00126862 0.0177865 ] [ 1.36937 1.35462 1.37323 ] [ -0.0302415 2.74811 2.64947 ] [ 1.37836 4.07615 4.08107 ] [ 2.65918 -0.0413914 2.54007 ] [ 4.19104 1.29728 4.08084 ] [ 2.79028 2.80414 0.0605432 ] [ 4.08315 4.18517 1.33386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.845640000000001e-13 1.26862e-13 1.77865e-12 ] [ 1.36937e-10 1.35462e-10 1.37323e-10 ] [ -3.02415e-12 2.74811e-10 2.64947e-10 ] [ 1.37836e-10 4.07615e-10 4.081070000000001e-10 ] [ 2.65918e-10 -4.13914e-12 2.54007e-10 ] [ 4.19104e-10 1.29728e-10 4.08084e-10 ] [ 2.79028e-10 2.80414e-10 6.05432e-12 ] [ 4.08315e-10 4.18517e-10 1.33386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6095077 0.9308966 -0.3789177 ] [ -0.6430094 1.2775381 -1.5280335 ] [ 0.3655439 -0.0832429 1.1316841 ] [ 0.0128923 -0.6649688 -0.4688258 ] [ 0.6731002 0.6710069 3.5666118 ] [ -1.5804747 0.482553 -0.7675574 ] [ -0.6046888 -1.0522511 -1.3379474 ] [ 1.1671288 -1.5615318 -0.2170142 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.765389871375802e-10 1.491460768902209e-09 -6.070930801473081e-10 ] [ -1.030214627634636e-09 2.046841676001253e-09 -2.448179549499197e-09 ] [ 5.856658904560531e-10 -1.333698282275923e-10 1.813157807151089e-09 ] [ 2.065574164833984e-11 -1.065397464921431e-09 -7.511417359878567e-10 ] [ 1.078425403895804e-09 1.075071567575483e-09 5.714342041429405e-09 ] [ -2.532199614105893e-09 7.731351348969024e-10 -1.229762521402034e-09 ] [ -9.688182582196071e-10 -1.685892111631083e-09 -2.143628044140146e-09 ] [ 1.869946476822359e-09 -2.501849742595742e-09 -3.476950776216153e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.310345 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.817558585218218e-18 } }